N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride

C14H27ClN2OS — CID 119817015

IUPACN-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCCSC1CCC(N(C)C(=O)CC2CCCN2)C1.Cl
InChIInChI=1S/C14H26N2OS.ClH/c1-3-18-13-7-6-12(10-13)16(2)14(17)9-11-5-4-8-15-11;/h11-13,15H,3-10H2,1-2H3;1H
InChIKeyQGZLAGLXQOGMDB-UHFFFAOYSA-N
MW306.90 g/mol
LogP2.68
Rot. Bonds5

About N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride

N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride (PubChem CID 119817015) has the molecular formula C14H27ClN2OS and a molecular weight of 306.90 g/mol. Its IUPAC name is N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride
PubChem CID119817015
Molecular FormulaC14H27ClN2OS
Molecular Weight306.90 g/mol
Exact Mass306.15
IUPAC NameN-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCCSC1CCC(N(C)C(=O)CC2CCCN2)C1.Cl
InChIInChI=1S/C14H26N2OS.ClH/c1-3-18-13-7-6-12(10-13)16(2)14(17)9-11-5-4-8-15-11;/h11-13,15H,3-10H2,1-2H3;1H
InChIKeyQGZLAGLXQOGMDB-UHFFFAOYSA-N
XLogP2.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.90
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethylsulfanylcyclopentyl)-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119342642
N-cycloheptyl-N-methyl-2-pyrrolidin-2-ylacetamide
CID 61370216
N,N-dimethyl-2-[(2R)-pyrrolidin-2-yl]acetamide
CID 66777504
(2S)-2-amino-N-(3-ethylsulfanylcyclopentyl)-N-methylpropanamide;hydrochloride
CID 119342646
N-(1-ethylpiperidin-4-yl)-N-methyl-2-piperidin-2-ylacetamide
CID 55002831
N-methyl-N-(1-methylpiperidin-4-yl)-2-piperidin-2-ylacetamide
CID 43151295
N-cyclopropyl-N-propan-2-yl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119728069
(2R,3S)-N-(3-ethylsulfanylcyclopentyl)-N,2-dimethylmorpholine-3-carboxamide
CID 120936821
(4S)-N-[(1S,3R)-3-ethylsulfanylcyclopentyl]-N-methyl-1,3-thiazolidine-4-carboxamide
CID 124683336
N-methyl-N-pentan-3-yl-2-pyrrolidin-2-ylacetamide
CID 61371384
N-(1,1-dioxothiolan-3-yl)-N-methyl-2-piperidin-2-ylacetamide
CID 43648898
N-(1-ethyl-3-methylpiperidin-4-yl)-N-methyl-2-pyrrolidin-2-ylacetamide
CID 119893453

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
The IUPAC name of N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride (CID 119817015) is N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride is CCSC1CCC(N(C)C(=O)CC2CCCN2)C1.Cl.
What is the InChIKey of N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
The InChIKey is QGZLAGLXQOGMDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2OS.ClH/c1-3-18-13-7-6-12(10-13)16(2)14(17)9-11-5-4-8-15-11;/h11-13,15H,3-10H2,1-2H3;1H.
What are the key properties of N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride has a molecular weight of 306.90 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylsulfanylcyclopentyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119817015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).